pyridin-3-yl-[4-(3,4,5-trimethoxyphenyl)carbonylpiperazin-1-yl]methanone chloride

Systemtic Name: pyridin-3-yl-[4-(3,4,5-trimethoxyphenyl)carbonylpiperazin-1-yl]methanone chloride Openeye Name: 3-pyridyl-[4-(3,4,5-trimethoxybenzoyl)piperazin-1-yl]methanone chloride CAS Name: [4-[oxo-(3,4,5-trimethoxyphenyl)methyl]-1-piperazinyl]-(3-pyridinyl)methanone chloride IUPAC Name: pyridin-3-yl-[4-(3,4,5-trimethoxybenzoyl)piperazin-1-yl]methanone chloride Traditional Name: 3-pyridyl-[4-(3,4,5-trimethoxybenzoyl)piperazino]methanone chloride Formula: C20H23ClN3O5- MolecularWeight: 420.86672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)N2CCN(CC2)C(=O)C3=CN=CC=C3.[Cl-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)N2CCN(CC2)C(=O)C3=CN=CC=C3.[Cl-]

InChI

InChI=1S/C20H23N3O5.ClH/c1-26-16-11-15(12-17(27-2)18(16)28-3)20(25)23-9-7-22(8-10-23)19(24)14-5-4-6-21-13-14;/h4-6,11-13H,7-10H2,1-3H3;1H/p-1